Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ACACB | O00763 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 5/20 | 0.33 |
| ▸ | ITK | Q08881 | 1/20 | 0.33 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.33 |
| ▸ | BTK | Q06187 | 2/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | SRC | P12931 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL3633598 | 0.86 | KCNQ3 (0.38) | KMT2AMEN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL3634094 | 0.86 | MDM2 (0.34) | KMT2AALDH1A1MEN1MAPTEGFR | |
| SCHEMBL3630762 | 0.84 | KMT2A (0.45) | KMT2AALDH1A1MEN1EGFRRAB9A | |
| SCHEMBL3633099 | 0.83 | CHRNA7 (0.40) | KMT2AMEN1MAPTKDM4EEGFR | |
| SCHEMBL3942557 | 0.82 | EGFR (0.32) | KMT2AALDH1A1MEN1MAPTKDM4E | |
| SCHEMBL3636515 | 0.81 | KDM4E (0.41) | ALDH1A1MAPTKDM4EMDM2RAB9A | |
| SCHEMBL3636480 | 0.80 | LMNA (0.34) | KMT2AALDH1A1CYP1A2CYP3A4EGFR | |
| SCHEMBL27800296 | 0.70 | MAPT (0.45) | KMT2AALDH1A1MEN1MAPTKDM4E | |
| SCHEMBL846971 | 0.69 | STAT6 (0.38) | EGFRITKBTKPPARGSMN1; SMN2 | |
| SCHEMBL3635507 | 0.66 | ABL1 (0.34) | KMT2AALDH1A1CYP1A2CYP3A4EGFR |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2148862-A1 | DIHYDROQUINONE AND DIHYDRONAPHTHRIDINE INHIBITORS OF JNK | F. Hoffmann-Roche AG (CH) | 2010-02-03 | — | — | EP | disclosed |
| WO-2009015917-A2 | DIHYDROQUINONE AND DIHYDRONAPHTHRIDINE INHIBITORS OF JNK | F. HOFFMANN-LA ROCHE AG (CH) | 2009-02-05 | — | — | WO | disclosed |
| WO-2008138920-A1 | DIHYDROQUINONE AND DIHYDRONAPHTHRIDINE INHIBITORS OF JNK | F. HOFFMANN-LA ROCHE AG (CH) | 2008-11-20 | — | — | WO | disclosed |